| SpectraBase Compound ID | GWoGAMfYLuV |
|---|---|
| InChI | InChI=1S/C20H33NO2/c1-18(2)12-9-7-5-3-4-6-8-10-14-20(22)23-17-19-13-11-15-21-16-19/h11,13,15-16,18H,3-10,12,14,17H2,1-2H3 |
| InChIKey | UCGWHHNXKDFBLP-UHFFFAOYSA-N |
| Mol Weight | 319.5 g/mol |
| Molecular Formula | C20H33NO2 |
| Exact Mass | 319.251129 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8VRKe3Zx6cE |
|---|---|
| Name | Picolinyl 12-methyltridecanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 319.251129305 u |
| Formula | C20H33NO2 |
| InChI | InChI=1S/C20H33NO2/c1-18(2)12-9-7-5-3-4-6-8-10-14-20(22)23-17-19-13-11-15-21-16-19/h11,13,15-16,18H,3-10,12,14,17H2,1-2H3 |
| InChIKey | UCGWHHNXKDFBLP-UHFFFAOYSA-N |
| Molecular Weight | 319.489 g/mol |
| SMILES | C1=CN=CC(=C1)COC(CCCCCCCCCCC(C)C)=O |